In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2008 | 32 | Yes |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.32 | 5.44 | -62.63 | 2 | 9 | 1 | 106 | 462.548 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.32 | 2.89 | -25.3 | 1 | 9 | 0 | 105 | 461.54 | 8 | ↓ |